Compound Identification
SMILES
CN1CCN(CC1)C1=C(NC(=O)CSC2=NN=C(O2)C2=CC(Br)=CC=C2)C=C(C=C1)C(F)(F)F
InChIKey
InChIKey=PMUKIKQLWCKZJH-UHFFFAOYSA-N
Formula
C22H21BrF3N5O2S
Mass
556.4
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazinanes
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Subclass
Piperazines
- Level 5 Phenylpiperazines
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Subclass
Piperazines
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Class
Diazinanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpiperazines
Alternative Parents
N-arylpiperazines Trifluoromethylbenzenes 2'-Aminoanilides Aniline and substituted anilines Dialkylarylamines N-arylamides Bromobenzenes N-methylpiperazines Alkylarylthioethers Aryl bromides Heteroaromatic compounds 1,3,4-oxadiazoles Secondary carboxylic acid amides Amino acids and derivatives Trialkylamines Oxacyclic compounds Sulfenyl compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Alkyl fluorides Organobromides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpiperazine - N-arylpiperazine - Trifluoromethylbenzene - 2'-aminoanilide - Anilide - Tertiary aliphatic/aromatic amine - N-arylamide - Aryl thioether - Dialkylarylamine - Aniline or substituted anilines - Halobenzene - Bromobenzene - Alkylarylthioether - N-alkylpiperazine - N-methylpiperazine - Aryl bromide - Benzenoid - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Oxadiazole - 1,3,4-oxadiazole - Azole - Carboxamide group - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Secondary carboxylic acid amide - Oxacycle - Azacycle - Sulfenyl compound - Thioether - Carboxylic acid derivative - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Alkyl fluoride - Alkyl halide - Amine - Organohalogen compound - Organobromide - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpiperazines. These are compounds containing a phenylpiperazine skeleton, which consists of a piperazine bound to a phenyl group.
External Descriptors
Not available